orbital_charges     :real:2:4,6
  0.176139876880452E+001  0.160473608114634E+001  0.199999980789396E+001
  0.136160567877321E+001  0.175549012447991E+001  0.178458516027593E+001
  0.124253505294905E+001  0.190443256717331E+001  0.637729310102673E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.655997321347172E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.645745063526961E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.645745063526961E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,6
  0.240786953607805E-002  0.545506850521379E-002  0.140946282423116E-016
  0.975107034498268E-003 -0.481934717860386E-002  0.111022302462516E-015
 -0.913238201243893E-004 -0.203070614619534E-002 -0.390312782094782E-017
 -0.806384720634767E-003 -0.317480160255013E-002 -0.116009632455949E-016
 -0.124263401490859E-002  0.228489321106776E-002 -0.252366886489275E-003
 -0.124263401490866E-002  0.228489321106785E-002  0.252366886489164E-003
mermin_energy       :real:0:
 -0.818210048754725E+001
end_coords          :real:2:3,6
 -0.271996687824347E+001 -0.290459199238930E+000  0.000000000000000E+000
  0.265936003987201E+001  0.299038290665440E+000  0.000000000000000E+000
 -0.899423417955748E+000  0.248003103398725E-001  0.000000000000000E+000
 -0.353654930089408E+001  0.134700139007677E+001  0.000000000000000E+000
  0.321499885570477E+001 -0.633830442699172E+000 -0.147227765644173E+001
  0.321499885570477E+001 -0.633830442699172E+000  0.147227765644173E+001
